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3HK9

Crystal structure of uronate isomerase from Bacillus halodurans complexed with zinc and D-Glucuronate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X4A
Synchrotron siteNSLS
BeamlineX4A
Temperature [K]100
Detector technologyCCD
Collection date2007-05-02
DetectorADSC QUANTUM 4
Wavelength(s)0.97915
Spacegroup nameC 1 2 1
Unit cell lengths274.091, 156.880, 185.206
Unit cell angles90.00, 115.78, 90.00
Refinement procedure
Resolution24.950 - 2.100
R-factor0.229
Rwork0.227
R-free0.25800
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)2q08
RMSD bond length0.006
RMSD bond angle1.300
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareBALBES
Refinement softwareCNS (1.1)
Data quality characteristics
 Overall
Low resolution limit [Å]25.000
High resolution limit [Å]2.100
Rmerge0.074
Number of reflections404122
Completeness [%]98.7
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP729320% PEG 3350, 0.2M Ammonium citrate, pH 7.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K

220113

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